Compound Detail
CHEMBL350934
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Basic Information
| ChEMBL ID | CHEMBL350934 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | BCLMGFJGYYTZMW-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
345.2
MW (Da)
-0.67
ALogP
9
HBA
5
HBD
176.8
PSA (Ų)
0.45
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.62
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| HEp-2 CHEMBL614735 | IC50 | 5.62 | 5.62 | 2400.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| HEp-2 | IC50 | = | 2400.0 | nM | 5.62 | Cytotoxicity to human epidermoid carcinoma cells (HEP-2) | 8145223 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 8145223 | 10.1021/jm00032a006 | HEp-2 | 1 |
Data from ChEMBL 36 via Core Engine